Predicted protein targets (top 5)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HTR4 | Q13639 | 10/20 | 0.45 |
| ▸ | KCNH2 | Q12809 | 3/20 | 0.37 |
| ▸ | CACNA1I | Q9P0X4 | 2/20 | 0.37 |
| ▸ | IL1B | P01584 | 1/20 | 0.33 |
| ▸ | P2RX7 | Q99572 | 1/20 | 0.33 |
Click a target to see other patent compounds predicted against it — the reverse direction, in place.
Similar compounds — the chemically nearest patent molecules
Nearest neighbours by Morgan-fingerprint cosine across the patent-compound collection, with each neighbour's top predicted target and the predicted targets it shares with this molecule.
| Compound | similarity | top predicted | shared targets | |
|---|---|---|---|---|
| SCHEMBL4735415 | 0.91 | HTR4 (0.46) | HTR4KCNH2CACNA1IIL1BP2RX7 | |
| SCHEMBL3332945 | 0.90 | HTR4 (0.55) | HTR4KCNH2CACNA1IIL1BP2RX7 | |
| SCHEMBL4728029 | 0.86 | HTR4 (0.47) | HTR4KCNH2CACNA1I | |
| SCHEMBL4733629 | 0.85 | HTR4 (0.49) | HTR4KCNH2CACNA1I | |
| SCHEMBL4733399 | 0.84 | HTR4 (0.46) | HTR4KCNH2 | |
| SCHEMBL2338462 | 0.80 | HTR4 (0.56) | HTR4KCNH2CACNA1IIL1BP2RX7 | |
| SCHEMBL2337922 | 0.77 | HTR4 (0.51) | HTR4KCNH2CACNA1IIL1BP2RX7 | |
| SCHEMBL2337664 | 0.76 | HTR4 (0.45) | HTR4KCNH2CACNA1IIL1BP2RX7 | |
| SCHEMBL2337661 | 0.76 | HTR4 (0.45) | HTR4KCNH2CACNA1IIL1BP2RX7 | |
| SCHEMBL2336140 | 0.76 | HTR4 (0.59) | HTR4KCNH2CACNA1I |
Similarity is cosine over the 2,048-bit Morgan fingerprint (≈ Tanimoto). Identical fingerprints score 1.00.
Patent provenance — the patents this molecule appears in, and who filed them
Claimed or disclosed in 1 patent. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-1713797-B1 | 1-ISOPROPYL-2-OXO-1,2-DIHYDROPYRIDINE-3-CARBOXAMIDE DERIVATIVES HAVING 5-HT4 RECEPTOR AGONISTIC ACTIVITY | PFIZER (US) | 2008-03-05 | — | — | EP | claimed |